10967/197 - QDB Compounds

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Gharagheizi, F. Prediction of upper flammability limit percent of pure compounds from their molecular structures. J. Hazard. Mater. 2009, 167, 507–510.

Compound

ID:191
Name:Benzene, cyclohexyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H16/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
5.4

experimental value

5.75

Eq.1: Model for diverse and pure compounds (Training set)

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